Compound Detail
CHEMBL2164254
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
CCNC(=O)ON(C)C(=O)COC(c1ccc(F)c(F)c1)P(=O)(OCOC(=O)C(C)(C)C)OCOC(=O)C(C)(C)C
Basic Information
| ChEMBL ID | CHEMBL2164254 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VLURCWGCCFHVRS-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
610.5
MW (Da)
4.42
ALogP
11
HBA
1
HBD
156.0
PSA (Ų)
0.15
QED
2
Ro5 Violations
12
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 7.66 | 7.585 | 22.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 22.0 | nM | 7.66 | Antiplasmodial activity against chloroquine-resistant Plasmodium falciparum Dd2 ... | 22731758 |
| Plasmodium falciparum | IC50 | = | 31.0 | nM | 7.51 | Antiplasmodial activity against chloroquine-sensitive Plasmodium falciparum 3D7 ... | 22731758 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22731758 | 10.1021/jm300652f | Plasmodium falciparum | 2 |
| 22731758 | 10.1021/jm300652f | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine